3-[3-(3-chloranyl-4-fluoranyl-phenyl)-5-(4-oxidanylideneimidazolidin-1-yl)carbonyl-thiophen-2-yl]-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[3-(3-chloranyl-4-fluoranyl-phenyl)-5-(4-oxidanylideneimidazolidin-1-yl)carbonyl-thiophen-2-yl]-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-[3-(3-chloro-4-fluoro-phenyl)-5-(4-oxoimidazolidine-1-carbonyl)-2-thienyl]-5-fluoro-benzonitrile CAS Name: 3-[3-(3-chloro-4-fluorophenyl)-5-[oxo-(4-oxo-1-imidazolidinyl)methyl]-2-thiophenyl]-5-fluorobenzonitrile IUPAC Name: 3-[3-(3-chloro-4-fluorophenyl)-5-(4-oxoimidazolidine-1-carbonyl)thiophen-2-yl]-5-fluorobenzonitrile Traditional Name: 3-[3-(3-chloro-4-fluoro-phenyl)-5-(4-ketoimidazolidine-1-carbonyl)-2-thienyl]-5-fluoro-benzonitrile Formula: C21H12ClF2N3O2S MolecularWeight: 443.853686

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NCN1C(=O)C2=CC(=C(S2)C3=CC(=CC(=C3)C#N)F)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1C(=O)NCN1C(=O)C2=CC(=C(S2)C3=CC(=CC(=C3)C#N)F)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H12ClF2N3O2S/c22-16-6-12(1-2-17(16)24)15-7-18(21(29)27-9-19(28)26-10-27)30-20(15)13-3-11(8-25)4-14(23)5-13/h1-7H,9-10H2,(H,26,28)